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*** ***elNémo ID: 2605022033524035196Job options:ID = 2605022033524035196 JOBID = USERID = unknown PRIVAT = 0 NMODES = 25 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:ATOM 82 N GLU A 11 -9.167 -10.794 -5.770 1.00 76.68 A N ATOM 83 CA GLU A 11 -9.984 -11.506 -4.786 1.00 79.32 A C ATOM 84 C GLU A 11 -9.143 -12.163 -3.682 1.00 81.14 A C ATOM 85 O GLU A 11 -9.514 -12.084 -2.511 1.00 80.23 A O ATOM 86 CB GLU A 11 -10.845 -12.549 -5.494 1.00 76.32 A C ATOM 87 CG GLU A 11 -12.029 -11.894 -6.224 1.00 69.25 A C ATOM 88 CD GLU A 11 -12.776 -12.845 -7.178 1.00 64.09 A C ATOM 89 OE1 GLU A 11 -13.542 -12.309 -8.006 1.00 58.24 A O ATOM 90 OE2 GLU A 11 -12.549 -14.070 -7.096 1.00 57.23 A O1- ATOM 91 N LYS A 12 -7.987 -12.722 -4.004 1.00 81.22 A N ATOM 92 CA LYS A 12 -7.059 -13.280 -3.001 1.00 81.70 A C ATOM 93 C LYS A 12 -6.609 -12.240 -1.974 1.00 83.16 A C ATOM 94 O LYS A 12 -6.457 -12.579 -0.801 1.00 82.04 A O ATOM 95 CB LYS A 12 -5.822 -13.877 -3.700 1.00 80.38 A C ATOM 96 CG LYS A 12 -6.077 -15.203 -4.427 1.00 76.70 A C ATOM 97 CD LYS A 12 -4.816 -15.612 -5.213 1.00 73.76 A C ATOM 98 CE LYS A 12 -5.017 -16.863 -6.080 1.00 68.13 A C ATOM 99 NZ LYS A 12 -3.794 -17.173 -6.860 1.00 60.73 A N1+ ATOM 100 N ALA A 13 -6.414 -10.995 -2.407 1.00 81.70 A N ATOM 101 CA ALA A 13 -5.976 -9.899 -1.550 1.00 81.91 A C ATOM 102 C ALA A 13 -7.120 -9.261 -0.741 1.00 83.01 A C ATOM 103 O ALA A 13 -6.845 -8.545 0.234 1.00 81.93 A O ATOM 104 CB ALA A 13 -5.270 -8.868 -2.423 1.00 80.43 A C ATOM 105 N VAL A 14 -8.383 -9.505 -1.111 1.00 81.74 A N ATOM 106 CA VAL A 14 -9.548 -8.982 -0.391 1.00 82.77 A C ATOM 107 C VAL A 14 -9.590 -9.530 1.040 1.00 82.92 A C ATOM 108 O VAL A 14 -9.412 -10.728 1.285 1.00 81.79 A O ATOM 109 CB VAL A 14 -10.865 -9.251 -1.150 1.00 80.99 A C ATOM 110 CG1 VAL A 14 -12.118 -8.906 -0.333 1.00 75.34 A C ATOM 111 CG2 VAL A 14 -10.925 -8.397 -2.424 1.00 74.72 A C ATOM 112 N GLY A 15 -9.853 -8.636 1.974 1.00 83.08 A N ATOM 113 CA GLY A 15 -9.966 -8.913 3.396 1.00 83.01 A C ATOM 114 C GLY A 15 -9.109 -7.995 4.258 1.00 84.89 A C ATOM 115 O GLY A 15 -8.447 -7.081 3.758 1.00 83.93 A O ATOM 116 N THR A 16 -9.125 -8.251 5.543 1.00 83.60 A N ATOM 117 CA THR A 16 -8.318 -7.545 6.537 1.00 84.48 A C ATOM 118 C THR A 16 -7.103 -8.381 6.921 1.00 85.49 A C ATOM 119 O THR A 16 -7.193 -9.593 7.134 1.00 84.65 A O ATOM 120 CB THR A 16 -9.141 -7.156 7.772 1.00 81.92 A C ATOM 121 CG2 THR A 16 -8.358 -6.311 8.774 1.00 75.01 A C ATOM 122 OG1 THR A 16 -10.242 -6.380 7.356 1.00 77.10 A O ATOM 123 N TRP A 17 -5.967 -7.718 7.001 1.00 85.74 A N ATOM 124 CA TRP A 17 -4.659 -8.295 7.270 1.00 86.10 A C ATOM 125 C TRP A 17 -3.999 -7.551 8.422 1.00 85.67 A C ATOM 126 O TRP A 17 -4.038 -6.326 8.447 1.00 84.26 A O ATOM 127 CB TRP A 17 -3.830 -8.204 5.997 1.00 86.98 A C ATOM 128 CG TRP A 17 -4.410 -8.866 4.783 1.00 86.72 A C ATOM 129 CD1 TRP A 17 -5.296 -8.314 3.917 1.00 85.18 A C ATOM 130 CD2 TRP A 17 -4.161 -10.220 4.299 1.00 87.04 A C ATOM 131 CE2 TRP A 17 -4.926 -10.410 3.108 1.00 84.82 A C ATOM 132 CE3 TRP A 17 -3.357 -11.282 4.741 1.00 85.04 A C ATOM 133 NE1 TRP A 17 -5.608 -9.223 2.925 1.00 83.59 A N ATOM 134 CZ2 TRP A 17 -4.877 -11.613 2.380 1.00 85.49 A C ATOM 135 CZ3 TRP A 17 -3.303 -12.494 4.017 1.00 85.44 A C ATOM 136 CH2 TRP A 17 -4.056 -12.658 2.841 1.00 84.09 A C ATOM 137 N LYS A 18 -3.396 -8.267 9.350 1.00 85.73 A N ATOM 138 CA LYS A 18 -2.620 -7.696 10.458 1.00 85.04 A C ATOM 139 C LYS A 18 -1.143 -7.963 10.253 1.00 86.11 A C ATOM 140 O LYS A 18 -0.787 -9.074 9.862 1.00 85.87 A O ATOM 141 CB LYS A 18 -3.069 -8.268 11.800 1.00 82.68 A C ATOM 142 CG LYS A 18 -4.419 -7.700 12.237 1.00 74.89 A C ATOM 143 CD LYS A 18 -4.715 -8.114 13.685 1.00 69.46 A C ATOM 144 CE LYS A 18 -5.986 -7.416 14.139 1.00 62.32 A C ATOM 145 NZ LYS A 18 -6.278 -7.644 15.579 1.00 54.50 A N1+ ATOM 146 N ILE A 19 -0.312 -6.976 10.558 1.00 85.67 A N ATOM 147 CA ILE A 19 1.135 -7.142 10.475 1.00 85.58 A C ATOM 148 C ILE A 19 1.577 -8.333 11.325 1.00 84.67 A C ATOM 149 O ILE A 19 1.097 -8.552 12.434 1.00 84.26 A O ATOM 150 CB ILE A 19 1.863 -5.822 10.801 1.00 83.63 A C ATOM 151 CG1 ILE A 19 3.319 -5.876 10.288 1.00 80.08 A C ATOM 152 CG2 ILE A 19 1.791 -5.468 12.296 1.00 79.30 A C ATOM 153 CD1 ILE A 19 3.957 -4.498 10.154 1.00 75.16 A C ATOM 154 N ALA A 20 2.433 -9.148 10.749 1.00 85.71 A N ATOM 155 CA ALA A 20 3.009 -10.325 11.380 1.00 85.60 A C ATOM 156 C ALA A 20 4.524 -10.195 11.521 1.00 85.72 A C ATOM 157 O ALA A 20 5.082 -10.758 12.459 1.00 84.42 A O ATOM 158 CB ALA A 20 2.631 -11.554 10.548 1.00 85.13 A C ATOM 159 N ASP A 21 5.153 -9.458 10.610 1.00 86.27 A N ATOM 160 CA ASP A 21 6.599 -9.263 10.588 1.00 86.21 A C ATOM 161 C ASP A 21 6.958 -8.012 9.771 1.00 86.25 A C ATOM 162 O ASP A 21 6.239 -7.662 8.833 1.00 86.07 A O ATOM 163 CB ASP A 21 7.234 -10.514 9.984 1.00 85.54 A C ATOM 164 CG ASP A 21 8.715 -10.654 10.303 1.00 78.69 A C ATOM 165 OD1 ASP A 21 9.247 -9.803 11.037 1.00 74.69 A O ATOM 166 OD2 ASP A 21 9.272 -11.652 9.789 1.00 72.31 A O1- ATOM 167 N SER A 22 8.049 -7.345 10.136 1.00 85.39 A N ATOM 168 CA SER A 22 8.516 -6.105 9.519 1.00 84.57 A C ATOM 169 C SER A 22 10.038 -6.082 9.486 1.00 84.83 A C ATOM 170 O SER A 22 10.690 -6.296 10.503 1.00 83.92 A O ATOM 171 CB SER A 22 7.993 -4.900 10.300 1.00 82.16 A C ATOM 172 OG SER A 22 8.417 -3.698 9.692 1.00 74.50 A O ATOM 173 N HIS A 23 10.605 -5.806 8.325 1.00 82.88 A N ATOM 174 CA HIS A 23 12.036 -5.705 8.102 1.00 83.25 A C ATOM 175 C HIS A 23 12.364 -4.399 7.389 1.00 83.21 A C ATOM 176 O HIS A 23 11.865 -4.143 6.290 1.00 82.65 A O ATOM 177 CB HIS A 23 12.515 -6.906 7.275 1.00 82.74 A C ATOM 178 CG HIS A 23 12.458 -8.217 8.016 1.00 74.10 A C ATOM 179 CD2 HIS A 23 13.498 -8.811 8.673 1.00 61.64 A C ATOM 180 ND1 HIS A 23 11.370 -9.045 8.153 1.00 65.10 A N ATOM 181 CE1 HIS A 23 11.762 -10.110 8.878 1.00 58.51 A C ATOM 182 NE2 HIS A 23 13.061 -10.019 9.210 1.00 57.83 A N ATOM 183 N ASN A 24 13.251 -3.614 7.991 1.00 80.83 A N ATOM 184 CA ASN A 24 13.834 -2.411 7.389 1.00 80.78 A C ATOM 185 C ASN A 24 12.831 -1.270 7.076 1.00 79.89 A C ATOM 186 O ASN A 24 13.151 -0.357 6.321 1.00 77.09 A O ATOM 187 CB ASN A 24 14.680 -2.853 6.175 1.00 79.22 A C ATOM 188 CG ASN A 24 15.770 -1.876 5.816 1.00 75.02 A C ATOM 189 ND2 ASN A 24 16.097 -1.750 4.554 1.00 69.44 A N ATOM 190 OD1 ASN A 24 16.382 -1.263 6.674 1.00 71.19 A O ATOM 191 N GLU A 25 11.631 -1.296 7.642 1.00 78.41 A N ATOM 192 CA GLU A 25 10.586 -0.301 7.341 1.00 75.83 A C ATOM 193 C GLU A 25 11.001 1.121 7.769 1.00 73.85 A C ATOM 194 O GLU A 25 10.683 2.086 7.074 1.00 67.03 A O ATOM 195 CB GLU A 25 9.270 -0.715 8.021 1.00 72.36 A C ATOM 196 CG GLU A 25 8.051 0.165 7.655 1.00 67.11 A C ATOM 197 CD GLU A 25 7.655 0.139 6.168 1.00 65.30 A C ATOM 198 OE1 GLU A 25 6.905 1.054 5.745 1.00 60.23 A O ATOM 199 OE2 GLU A 25 8.036 -0.807 5.451 1.00 60.26 A O1- ATOM 200 N GLY A 26 11.765 1.255 8.845 1.00 74.19 A N ATOM 201 CA GLY A 26 12.256 2.544 9.349 1.00 73.14 A C ATOM 202 C GLY A 26 13.243 3.257 8.426 1.00 74.70 A C ATOM 203 O GLY A 26 13.383 4.484 8.503 1.00 71.21 A O ATOM 204 N GLU A 27 13.897 2.535 7.514 1.00 74.29 A N ATOM 205 CA GLU A 27 14.849 3.136 6.568 1.00 76.83 A C ATOM 206 C GLU A 27 14.157 3.753 5.347 1.00 77.99 A C ATOM 207 O GLU A 27 14.654 4.732 4.777 1.00 74.69 A O ATOM 208 CB GLU A 27 15.899 2.093 6.161 1.00 75.15 A C ATOM 209 CG GLU A 27 16.761 1.598 7.337 1.00 72.40 A C ATOM 210 CD GLU A 27 17.457 2.753 8.083 1.00 68.78 A C ATOM 211 OE1 GLU A 27 17.301 2.857 9.324 1.00 63.19 A O ATOM 212 OE2 GLU A 27 18.079 3.611 7.420 1.00 64.48 A O1- ATOM 213 N SER A 28 12.978 3.264 4.962 1.00 74.29 A N ATOM 214 CA SER A 28 12.251 3.765 3.792 1.00 71.88 A C ATOM 215 C SER A 28 11.854 5.250 3.905 1.00 71.09 A C ATOM 216 O SER A 28 12.104 6.003 2.956 1.00 68.90 A O ATOM 217 CB SER A 28 11.016 2.890 3.511 1.00 68.69 A C ATOM 218 OG SER A 28 11.407 1.577 3.206 1.00 61.73 A O ATOM 219 N PRO A 29 11.304 5.751 5.025 1.00 70.52 A N ATOM 220 CA PRO A 29 11.038 7.176 5.193 1.00 69.06 A C ATOM 221 C PRO A 29 12.303 8.035 5.153 1.00 68.63 A C ATOM 222 O PRO A 29 12.277 9.135 4.598 1.00 67.16 A O ATOM 223 CB PRO A 29 10.314 7.303 6.536 1.00 66.84 A C ATOM 224 CG PRO A 29 9.693 5.930 6.743 1.00 65.33 A C ATOM 225 CD PRO A 29 10.748 5.010 6.139 1.00 69.89 A C ATOM 226 N LYS A 30 13.431 7.537 5.680 1.00 72.90 A N ATOM 227 CA LYS A 30 14.723 8.236 5.631 1.00 73.90 A C ATOM 228 C LYS A 30 15.203 8.398 4.190 1.00 74.27 A C ATOM 229 O LYS A 30 15.582 9.501 3.798 1.00 72.47 A O ATOM 230 CB LYS A 30 15.782 7.492 6.469 1.00 72.31 A C ATOM 231 CG LYS A 30 15.413 7.370 7.956 1.00 69.80 A C ATOM 232 CD LYS A 30 16.478 6.538 8.686 1.00 67.77 A C ATOM 233 CE LYS A 30 15.986 6.134 10.076 1.00 63.64 A C ATOM 234 NZ LYS A 30 16.837 5.071 10.650 1.00 56.79 A N1+ ATOM 235 N ALA A 31 15.109 7.348 3.380 1.00 76.21 A N ATOM 236 CA ALA A 31 15.446 7.383 1.959 1.00 76.26 A C ATOM 237 C ALA A 31 14.552 8.365 1.162 1.00 75.70 A C ATOM 238 O ALA A 31 15.005 9.007 0.213 1.00 72.93 A O ATOM 239 CB ALA A 31 15.346 5.964 1.400 1.00 75.60 A C ATOM 240 N ASN A 32 13.297 8.541 1.586 1.00 75.09 A N ATOM 241 CA ASN A 32 12.377 9.525 1.017 1.00 71.77 A C ATOM 242 C ASN A 32 12.727 10.980 1.387 1.00 70.82 A C ATOM 243 O ASN A 32 12.165 11.904 0.797 1.00 65.69 A O ATOM 244 CB ASN A 32 10.941 9.162 1.441 1.00 68.16 A C ATOM 245 CG ASN A 32 10.392 7.971 0.686 1.00 63.17 A C ATOM 246 ND2 ASN A 32 9.413 7.280 1.216 1.00 58.68 A N ATOM 247 OD1 ASN A 32 10.795 7.689 -0.419 1.00 58.89 A O ATOM 248 N GLY A 33 13.638 11.199 2.334 1.00 69.98 A N ATOM 249 CA GLY A 33 13.924 12.518 2.893 1.00 69.94 A C ATOM 250 C GLY A 33 12.811 13.020 3.813 1.00 70.86 A C ATOM 251 O GLY A 33 12.613 14.227 3.915 1.00 67.34 A O ATOM 252 N ALA A 34 12.055 12.116 4.420 1.00 66.83 A N ATOM 253 CA ALA A 34 11.047 12.479 5.404 1.00 66.17 A C ATOM 254 C ALA A 34 11.697 13.090 6.659 1.00 65.38 A C ATOM 255 O ALA A 34 12.805 12.692 7.026 1.00 62.79 A O ATOM 256 CB ALA A 34 10.194 11.253 5.742 1.00 63.51 A C ATOM 257 N PRO A 35 11.016 14.016 7.344 1.00 62.11 A N ATOM 258 CA PRO A 35 11.470 14.533 8.625 1.00 62.93 A C ATOM 259 C PRO A 35 11.727 13.405 9.624 1.00 64.24 A C ATOM 260 O PRO A 35 11.007 12.403 9.629 1.00 62.01 A O ATOM 261 CB PRO A 35 10.366 15.472 9.117 1.00 59.76 A C ATOM 262 CG PRO A 35 9.652 15.888 7.841 1.00 58.95 A C ATOM 263 CD PRO A 35 9.760 14.646 6.964 1.00 65.05 A C ATOM 264 N LYS A 36 12.710 13.601 10.506 1.00 59.36 A N ATOM 265 CA LYS A 36 13.117 12.604 11.497 1.00 59.14 A C ATOM 266 C LYS A 36 11.952 12.122 12.375 1.00 59.27 A C ATOM 267 O LYS A 36 11.826 10.933 12.638 1.00 56.47 A O ATOM 268 CB LYS A 36 14.260 13.206 12.337 1.00 55.93 A C ATOM 269 CG LYS A 36 14.834 12.172 13.307 1.00 50.79 A C ATOM 270 CD LYS A 36 16.017 12.733 14.103 1.00 48.05 A C ATOM 271 CE LYS A 36 16.423 11.641 15.091 1.00 42.53 A C ATOM 272 NZ LYS A 36 17.526 12.064 15.977 1.00 37.76 A N1+ ATOM 273 N GLU A 37 11.041 13.009 12.712 1.00 57.10 A N ATOM 274 CA GLU A 37 9.837 12.732 13.511 1.00 56.01 A C ATOM 275 C GLU A 37 8.867 11.777 12.797 1.00 55.62 A C ATOM 276 O GLU A 37 8.035 11.131 13.433 1.00 51.90 A O ATOM 277 CB GLU A 37 9.107 14.050 13.819 1.00 53.33 A C ATOM 278 CG GLU A 37 9.943 15.134 14.522 1.00 47.15 A C ATOM 279 CD GLU A 37 10.971 15.861 13.616 1.00 42.14 A C ATOM 280 OE1 GLU A 37 11.881 16.510 14.172 1.00 38.40 A O ATOM 281 OE2 GLU A 37 10.883 15.733 12.372 1.00 41.19 A O1- ATOM 282 N SER A 38 8.957 11.691 11.460 1.00 58.55 A N ATOM 283 CA SER A 38 8.150 10.798 10.633 1.00 57.42 A C ATOM 284 C SER A 38 8.836 9.460 10.350 1.00 56.88 A C ATOM 285 O SER A 38 8.159 8.528 9.915 1.00 54.38 A O ATOM 286 CB SER A 38 7.805 11.472 9.303 1.00 55.27 A C ATOM 287 OG SER A 38 7.079 12.667 9.517 1.00 51.19 A O ATOM 288 N SER A 39 10.150 9.366 10.546 1.00 53.96 A N ATOM 289 CA SER A 39 10.954 8.160 10.335 1.00 53.40 A C ATOM 290 C SER A 39 11.262 7.401 11.622 1.00 54.39 A C ATOM 291 O SER A 39 11.340 6.175 11.601 1.00 51.66 A O ATOM 292 CB SER A 39 12.252 8.506 9.591 1.00 49.43 A C ATOM 293 OG SER A 39 13.028 9.478 10.264 1.00 45.47 A O ATOM 294 N ASP A 40 11.401 8.113 12.740 1.00 50.44 A N ATOM 295 CA ASP A 40 11.676 7.492 14.036 1.00 50.57 A C ATOM 296 C ASP A 40 10.418 6.772 14.555 1.00 51.37 A C ATOM 297 O ASP A 40 9.326 7.331 14.624 1.00 48.10 A O ATOM 298 CB ASP A 40 12.217 8.536 15.039 1.00 45.81 A C ATOM 299 CG ASP A 40 13.675 8.959 14.796 1.00 42.02 A C ATOM 300 OD1 ASP A 40 14.324 8.442 13.861 1.00 39.07 A O ATOM 301 OD2 ASP A 40 14.183 9.804 15.571 1.00 38.80 A O1- ATOM 302 N GLY A 41 10.563 5.490 14.905 1.00 50.53 A N ATOM 303 CA GLY A 41 9.478 4.658 15.434 1.00 49.75 A C ATOM 304 C GLY A 41 8.655 3.898 14.391 1.00 51.01 A C ATOM 305 O GLY A 41 7.731 3.183 14.769 1.00 48.10 A O ATOM 306 N THR A 42 8.977 3.987 13.086 1.00 50.92 A N ATOM 307 CA THR A 42 8.295 3.197 12.045 1.00 50.51 A C ATOM 308 C THR A 42 8.572 1.691 12.108 1.00 51.04 A C ATOM 309 O THR A 42 7.750 0.923 11.628 1.00 48.23 A O ATOM 310 CB THR A 42 8.571 3.736 10.626 1.00 47.33 A C ATOM 311 CG2 THR A 42 7.611 4.863 10.269 1.00 43.47 A C ATOM 312 OG1 THR A 42 9.855 4.268 10.508 1.00 44.21 A O ATOM 313 N ASP A 43 9.638 1.250 12.781 1.00 48.03 A N ATOM 314 CA ASP A 43 9.881 -0.179 13.042 1.00 48.83 A C ATOM 315 C ASP A 43 9.013 -0.741 14.184 1.00 49.95 A C ATOM 316 O ASP A 43 8.877 -1.958 14.337 1.00 47.45 A O ATOM 317 CB ASP A 43 11.375 -0.401 13.341 1.00 44.89 A C ATOM 318 CG ASP A 43 12.287 -0.161 12.133 1.00 41.41 A C ATOM 319 OD1 ASP A 43 11.851 -0.444 10.995 1.00 38.28 A O ATOM 320 OD2 ASP A 43 13.423 0.317 12.344 1.00 38.29 A O1- ATOM 321 N ALA A 44 8.374 0.119 14.984 1.00 44.70 A N ATOM 322 CA ALA A 44 7.564 -0.260 16.139 1.00 43.99 A C ATOM 323 C ALA A 44 6.070 -0.459 15.805 1.00 46.03 A C ATOM 324 O ALA A 44 5.208 -0.296 16.673 1.00 43.05 A O ATOM 325 CB ALA A 44 7.810 0.748 17.267 1.00 38.21 A C ATOM 326 N LEU A 45 5.738 -0.785 14.550 1.00 52.00 A N ATOM 327 CA LEU A 45 4.366 -0.899 14.059 1.00 51.77 A C ATOM 328 C LEU A 45 3.702 -2.222 14.467 1.00 53.42 A C ATOM 329 O LEU A 45 3.314 -3.039 13.630 1.00 49.85 A O ATOM 330 CB LEU A 45 4.350 -0.674 12.533 1.00 47.53 A C ATOM 331 CG LEU A 45 4.837 0.710 12.079 1.00 45.10 A C ATOM 332 CD1 LEU A 45 4.822 0.779 10.548 1.00 42.89 A C ATOM 333 CD2 LEU A 45 3.976 1.842 12.615 1.00 42.40 A C ATOM 334 N THR A 46 3.548 -2.456 15.772 1.00 50.16 A N ATOM 335 CA THR A 46 2.920 -3.667 16.322 1.00 51.28 A C ATOM 336 C THR A 46 1.419 -3.783 16.019 1.00 53.34 A C ATOM 337 O THR A 46 0.856 -4.872 16.097 1.00 50.95 A O ATOM 338 CB THR A 46 3.151 -3.762 17.838 1.00 47.24 A C ATOM 339 CG2 THR A 46 4.621 -4.003 18.164 1.00 41.82 A C ATOM 340 OG1 THR A 46 2.775 -2.554 18.464 1.00 42.27 A O ATOM 341 N GLU A 47 0.785 -2.685 15.594 1.00 57.34 A N ATOM 342 CA GLU A 47 -0.656 -2.605 15.298 1.00 58.54 A C ATOM 343 C GLU A 47 -0.934 -2.001 13.921 1.00 63.08 A C ATOM 344 O GLU A 47 -1.753 -1.097 13.770 1.00 60.49 A O ATOM 345 CB GLU A 47 -1.392 -1.851 16.420 1.00 53.11 A C ATOM 346 CG GLU A 47 -1.276 -2.536 17.783 1.00 46.82 A C ATOM 347 CD GLU A 47 -2.241 -1.940 18.810 1.00 43.20 A C ATOM 348 OE1 GLU A 47 -2.509 -2.649 19.803 1.00 39.50 A O ATOM 349 OE2 GLU A 47 -2.728 -0.813 18.588 1.00 43.06 A O1- ATOM 350 N THR A 48 -0.261 -2.490 12.879 1.00 66.19 A N ATOM 351 CA THR A 48 -0.607 -2.108 11.507 1.00 66.04 A C ATOM 352 C THR A 48 -1.597 -3.091 10.902 1.00 67.24 A C ATOM 353 O THR A 48 -1.394 -4.311 10.942 1.00 65.67 A O ATOM 354 CB THR A 48 0.626 -1.948 10.607 1.00 62.24 A C ATOM 355 CG2 THR A 48 0.283 -1.407 9.222 1.00 56.25 A C ATOM 356 OG1 THR A 48 1.468 -1.004 11.196 1.00 56.35 A O ATOM 357 N SER A 49 -2.662 -2.571 10.307 1.00 72.60 A N ATOM 358 CA SER A 49 -3.591 -3.343 9.492 1.00 72.59 A C ATOM 359 C SER A 49 -3.632 -2.829 8.057 1.00 74.22 A C ATOM 360 O SER A 49 -3.397 -1.667 7.762 1.00 74.55 A O ATOM 361 CB SER A 49 -4.987 -3.411 10.117 1.00 68.32 A C ATOM 362 OG SER A 49 -5.751 -2.273 9.792 1.00 58.50 A O ATOM 363 N TYR A 50 -3.953 -3.746 7.148 1.00 72.30 A N ATOM 364 CA TYR A 50 -4.214 -3.463 5.753 1.00 74.09 A C ATOM 365 C TYR A 50 -5.548 -4.084 5.368 1.00 74.54 A C ATOM 366 O TYR A 50 -5.766 -5.272 5.606 1.00 74.73 A O ATOM 367 CB TYR A 50 -3.060 -4.005 4.909 1.00 73.00 A C ATOM 368 CG TYR A 50 -3.299 -3.899 3.429 1.00 67.43 A C ATOM 369 CD1 TYR A 50 -3.884 -4.970 2.728 1.00 63.26 A C ATOM 370 CD2 TYR A 50 -2.966 -2.710 2.752 1.00 61.35 A C ATOM 371 CE1 TYR A 50 -4.114 -4.869 1.341 1.00 54.10 A C ATOM 372 CE2 TYR A 50 -3.203 -2.606 1.367 1.00 55.41 A C ATOM 373 CZ TYR A 50 -3.774 -3.683 0.659 1.00 54.22 A C ATOM 374 OH TYR A 50 -3.988 -3.590 -0.677 1.00 56.50 A O ATOM 375 N THR A 51 -6.436 -3.326 4.768 1.00 76.35 A N ATOM 376 CA THR A 51 -7.732 -3.811 4.284 1.00 75.79 A C ATOM 377 C THR A 51 -7.854 -3.538 2.795 1.00 76.05 A C ATOM 378 O THR A 51 -7.613 -2.417 2.341 1.00 76.25 A O ATOM 379 CB THR A 51 -8.904 -3.210 5.066 1.00 72.40 A C ATOM 380 CG2 THR A 51 -10.258 -3.753 4.622 1.00 63.90 A C ATOM 381 OG1 THR A 51 -8.772 -3.505 6.436 1.00 65.48 A O ATOM 382 N SER A 52 -8.238 -4.556 2.034 1.00 76.29 A N ATOM 383 CA SER A 52 -8.540 -4.451 0.609 1.00 74.83 A C ATOM 384 C SER A 52 -9.979 -4.867 0.366 1.00 74.94 A C ATOM 385 O SER A 52 -10.434 -5.899 0.862 1.00 76.16 A O ATOM 386 CB SER A 52 -7.576 -5.308 -0.201 1.00 72.25 A C ATOM 387 OG SER A 52 -7.797 -5.123 -1.579 1.00 62.95 A O ATOM 388 N GLN A 53 -10.713 -4.076 -0.411 1.00 81.07 A N ATOM 389 CA GLN A 53 -12.087 -4.362 -0.825 1.00 81.58 A C ATOM 390 C GLN A 53 -12.239 -4.119 -2.325 1.00 82.11 A C ATOM 391 O GLN A 53 -11.658 -3.187 -2.866 1.00 83.09 A O ATOM 392 CB GLN A 53 -13.077 -3.481 -0.058 1.00 79.83 A C ATOM 393 CG GLN A 53 -13.116 -3.795 1.444 1.00 71.18 A C ATOM 394 CD GLN A 53 -14.100 -2.903 2.198 1.00 66.96 A C ATOM 395 NE2 GLN A 53 -14.604 -3.340 3.321 1.00 57.63 A N ATOM 396 OE1 GLN A 53 -14.410 -1.793 1.801 1.00 63.81 A O ATOM 397 N LYS A 54 -13.033 -4.955 -2.980 1.00 80.67 A N ATOM 398 CA LYS A 54 -13.389 -4.789 -4.395 1.00 80.18 A C ATOM 399 C LYS A 54 -14.830 -4.302 -4.506 1.00 80.40 A C ATOM 400 O LYS A 54 -15.714 -4.856 -3.867 1.00 80.65 A O ATOM 401 CB LYS A 54 -13.140 -6.116 -5.127 1.00 77.14 A C ATOM 402 CG LYS A 54 -13.442 -6.028 -6.629 1.00 71.69 A C ATOM 403 CD LYS A 54 -13.013 -7.316 -7.329 1.00 69.08 A C ATOM 404 CE LYS A 54 -13.305 -7.305 -8.833 1.00 63.70 A C ATOM 405 NZ LYS A 54 -14.729 -7.590 -9.116 1.00 57.68 A N1+ ATOM 406 N ASP A 55 -15.044 -3.288 -5.329 1.00 82.10 A N ATOM 407 CA ASP A 55 -16.354 -2.722 -5.642 1.00 81.65 A C ATOM 408 C ASP A 55 -16.429 -2.423 -7.143 1.00 82.03 A C ATOM 409 O ASP A 55 -15.857 -1.445 -7.633 1.00 79.59 A O ATOM 410 CB ASP A 55 -16.597 -1.482 -4.776 1.00 79.19 A C ATOM 411 CG ASP A 55 -17.928 -0.782 -5.101 1.00 70.24 A C ATOM 412 OD1 ASP A 55 -18.804 -1.417 -5.708 1.00 65.15 A O ATOM 413 OD2 ASP A 55 -18.013 0.425 -4.766 1.00 64.75 A O1- ATOM 414 N GLY A 56 -17.062 -3.321 -7.888 1.00 79.96 A N ATOM 415 CA GLY A 56 -17.076 -3.294 -9.347 1.00 78.77 A C ATOM 416 C GLY A 56 -15.671 -3.403 -9.941 1.00 79.41 A C ATOM 417 O GLY A 56 -14.978 -4.398 -9.729 1.00 76.56 A O ATOM 418 N ASP A 57 -15.254 -2.390 -10.685 1.00 79.68 A N ATOM 419 CA ASP A 57 -13.923 -2.269 -11.299 1.00 78.96 A C ATOM 420 C ASP A 57 -12.911 -1.518 -10.412 1.00 81.13 A C ATOM 421 O ASP A 57 -11.757 -1.345 -10.803 1.00 79.75 A O ATOM 422 CB ASP A 57 -14.046 -1.646 -12.705 1.00 75.19 A C ATOM 423 CG ASP A 57 -14.391 -0.153 -12.732 1.00 69.46 A C ATOM 424 OD1 ASP A 57 -14.976 0.348 -11.746 1.00 65.39 A O ATOM 425 OD2 ASP A 57 -14.059 0.488 -13.763 1.00 65.44 A O1- ATOM 426 N LYS A 58 -13.330 -1.103 -9.221 1.00 78.65 A N ATOM 427 CA LYS A 58 -12.502 -0.354 -8.280 1.00 80.78 A C ATOM 428 C LYS A 58 -12.048 -1.219 -7.110 1.00 81.28 A C ATOM 429 O LYS A 58 -12.733 -2.133 -6.663 1.00 81.92 A O ATOM 430 CB LYS A 58 -13.231 0.906 -7.801 1.00 80.45 A C ATOM 431 CG LYS A 58 -13.488 1.871 -8.970 1.00 80.02 A C ATOM 432 CD LYS A 58 -14.191 3.150 -8.519 1.00 77.54 A C ATOM 433 CE LYS A 58 -14.444 4.015 -9.755 1.00 73.17 A C ATOM 434 NZ LYS A 58 -15.087 5.301 -9.432 1.00 65.87 A N1+ ATOM 435 N VAL A 59 -10.896 -0.871 -6.582 1.00 81.10 A N ATOM 436 CA VAL A 59 -10.323 -1.443 -5.368 1.00 80.98 A C ATOM 437 C VAL A 59 -10.168 -0.331 -4.341 1.00 81.23 A C ATOM 438 O VAL A 59 -9.624 0.731 -4.631 1.00 81.80 A O ATOM 439 CB VAL A 59 -8.997 -2.168 -5.654 1.00 79.54 A C ATOM 440 CG1 VAL A 59 -8.447 -2.836 -4.388 1.00 69.75 A C ATOM 441 CG2 VAL A 59 -9.188 -3.265 -6.705 1.00 70.11 A C ATOM 442 N THR A 60 -10.670 -0.579 -3.147 1.00 82.39 A N ATOM 443 CA THR A 60 -10.398 0.252 -1.974 1.00 82.23 A C ATOM 444 C THR A 60 -9.241 -0.363 -1.209 1.00 81.58 A C ATOM 445 O THR A 60 -9.293 -1.526 -0.826 1.00 81.61 A O ATOM 446 CB THR A 60 -11.634 0.387 -1.075 1.00 81.63 A C ATOM 447 CG2 THR A 60 -11.378 1.299 0.127 1.00 76.99 A C ATOM 448 OG1 THR A 60 -12.673 0.984 -1.812 1.00 77.34 A O ATOM 449 N LEU A 61 -8.207 0.435 -1.000 1.00 80.85 A N ATOM 450 CA LEU A 61 -7.031 0.088 -0.211 1.00 80.01 A C ATOM 451 C LEU A 61 -7.020 0.971 1.028 1.00 80.11 A C ATOM 452 O LEU A 61 -7.046 2.200 0.907 1.00 80.31 A O ATOM 453 CB LEU A 61 -5.764 0.303 -1.056 1.00 78.91 A C ATOM 454 CG LEU A 61 -5.729 -0.441 -2.400 1.00 73.31 A C ATOM 455 CD1 LEU A 61 -4.423 -0.107 -3.133 1.00 69.94 A C ATOM 456 CD2 LEU A 61 -5.822 -1.950 -2.238 1.00 70.04 A C ATOM 457 N LYS A 62 -6.974 0.357 2.189 1.00 79.84 A N ATOM 458 CA LYS A 62 -6.934 1.023 3.486 1.00 79.88 A C ATOM 459 C LYS A 62 -5.756 0.483 4.293 1.00 79.35 A C ATOM 460 O LYS A 62 -5.579 -0.725 4.387 1.00 79.87 A O ATOM 461 CB LYS A 62 -8.281 0.809 4.185 1.00 79.36 A C ATOM 462 CG LYS A 62 -8.401 1.556 5.511 1.00 71.67 A C ATOM 463 CD LYS A 62 -9.756 1.241 6.185 1.00 71.09 A C ATOM 464 CE LYS A 62 -9.825 1.968 7.515 1.00 63.62 A C ATOM 465 NZ LYS A 62 -10.835 1.424 8.450 1.00 57.63 A N1+ ATOM 466 N SER A 63 -4.964 1.378 4.849 1.00 78.58 A N ATOM 467 CA SER A 63 -3.917 1.038 5.806 1.00 77.37 A C ATOM 468 C SER A 63 -4.140 1.818 7.087 1.00 76.85 A C ATOM 469 O SER A 63 -4.425 3.018 7.022 1.00 76.23 A O ATOM 470 CB SER A 63 -2.523 1.324 5.246 1.00 75.70 A C ATOM 471 OG SER A 63 -2.373 2.698 4.951 1.00 66.49 A O ATOM 472 N GLU A 64 -3.997 1.168 8.216 1.00 73.25 A N ATOM 473 CA GLU A 64 -4.159 1.773 9.535 1.00 74.29 A C ATOM 474 C GLU A 64 -2.974 1.411 10.414 1.00 73.63 A C ATOM 475 O GLU A 64 -2.532 0.266 10.439 1.00 73.66 A O ATOM 476 CB GLU A 64 -5.466 1.297 10.175 1.00 73.03 A C ATOM 477 CG GLU A 64 -6.682 1.713 9.367 1.00 66.46 A C ATOM 478 CD GLU A 64 -7.989 1.126 9.933 1.00 65.27 A C ATOM 479 OE1 GLU A 64 -8.789 1.905 10.470 1.00 59.75 A O ATOM 480 OE2 GLU A 64 -8.252 -0.064 9.695 1.00 60.62 A O1- ATOM 481 N VAL A 65 -2.458 2.407 11.104 1.00 73.00 A N ATOM 482 CA VAL A 65 -1.350 2.304 12.039 1.00 71.44 A C ATOM 483 C VAL A 65 -1.881 2.694 13.408 1.00 69.99 A C ATOM 484 O VAL A 65 -2.417 3.791 13.566 1.00 67.08 A O ATOM 485 CB VAL A 65 -0.192 3.206 11.590 1.00 69.63 A C ATOM 486 CG1 VAL A 65 0.996 3.080 12.546 1.00 63.60 A C ATOM 487 CG2 VAL A 65 0.288 2.869 10.174 1.00 65.52 A C ATOM 488 N GLY A 66 -1.751 1.794 14.367 1.00 70.69 A N ATOM 489 CA GLY A 66 -2.116 2.012 15.757 1.00 69.62 A C ATOM 490 C GLY A 66 -1.125 2.909 16.516 1.00 69.23 A C ATOM 491 O GLY A 66 -0.320 3.617 15.906 1.00 66.85 A O ATOM 492 N PRO A 67 -1.184 2.913 17.864 1.00 68.39 A N ATOM 493 CA PRO A 67 -0.280 3.684 18.704 1.00 68.39 A C ATOM 494 C PRO A 67 1.201 3.396 18.413 1.00 68.14 A C ATOM 495 O PRO A 67 1.559 2.250 18.136 1.00 65.43 A O ATOM 496 CB PRO A 67 -0.655 3.324 20.147 1.00 66.52 A C ATOM 497 CG PRO A 67 -2.108 2.880 20.038 1.00 64.72 A C ATOM 498 CD PRO A 67 -2.159 2.200 18.669 1.00 69.31 A C ATOM 499 N PRO A 68 2.091 4.390 18.505 1.00 66.35 A N ATOM 500 CA PRO A 68 1.817 5.785 18.880 1.00 65.82 A C ATOM 501 C PRO A 68 1.368 6.686 17.716 1.00 67.00 A C ATOM 502 O PRO A 68 1.006 7.835 17.943 1.00 64.38 A O ATOM 503 CB PRO A 68 3.143 6.263 19.479 1.00 63.12 A C ATOM 504 CG PRO A 68 4.180 5.533 18.629 1.00 61.88 A C ATOM 505 CD PRO A 68 3.530 4.173 18.378 1.00 66.88 A C ATOM 506 N MET A 69 1.373 6.195 16.482 1.00 64.17 A N ATOM 507 CA MET A 69 1.135 7.005 15.275 1.00 64.58 A C ATOM 508 C MET A 69 -0.345 7.320 15.042 1.00 65.40 A C ATOM 509 O MET A 69 -0.652 8.392 14.528 1.00 62.32 A O ATOM 510 CB MET A 69 1.718 6.289 14.052 1.00 62.46 A C ATOM 511 CG MET A 69 3.245 6.136 14.103 1.00 58.17 A C ATOM 512 SD MET A 69 4.179 7.690 14.146 1.00 55.15 A S ATOM 513 CE MET A 69 3.925 8.299 12.470 1.00 52.46 A C ATOM 514 N ASN A 70 -1.256 6.398 15.381 1.00 69.68 A N ATOM 515 CA ASN A 70 -2.717 6.509 15.233 1.00 69.86 A C ATOM 516 C ASN A 70 -3.147 7.140 13.904 1.00 70.91 A C ATOM 517 O ASN A 70 -3.848 8.160 13.866 1.00 67.52 A O ATOM 518 CB ASN A 70 -3.307 7.208 16.468 1.00 66.11 A C ATOM 519 CG ASN A 70 -3.144 6.372 17.714 1.00 61.83 A C ATOM 520 ND2 ASN A 70 -2.555 6.921 18.751 1.00 58.44 A N ATOM 521 OD1 ASN A 70 -3.539 5.224 17.774 1.00 58.40 A O ATOM 522 N ARG A 71 -2.695 6.562 12.782 1.00 69.68 A N ATOM 523 CA ARG A 71 -2.897 7.133 11.450 1.00 70.74 A C ATOM 524 C ARG A 71 -3.538 6.127 10.520 1.00 72.20 A C ATOM 525 O ARG A 71 -3.168 4.961 10.492 1.00 69.07 A O ATOM 526 CB ARG A 71 -1.546 7.629 10.920 1.00 67.54 A C ATOM 527 CG ARG A 71 -1.687 8.397 9.594 1.00 62.08 A C ATOM 528 CD ARG A 71 -0.333 8.961 9.146 1.00 61.07 A C ATOM 529 NE ARG A 71 0.622 7.891 8.816 1.00 55.60 A N ATOM 530 CZ ARG A 71 1.929 8.024 8.668 1.00 49.87 A C ATOM 531 NH1 ARG A 71 2.526 9.183 8.776 1.00 47.36 A N1+ ATOM 532 NH2 ARG A 71 2.675 6.994 8.390 1.00 43.76 A N ATOM 533 N GLY A 72 -4.452 6.609 9.680 1.00 73.39 A N ATOM 534 CA GLY A 72 -5.029 5.805 8.613 1.00 74.36 A C ATOM 535 C GLY A 72 -4.986 6.526 7.272 1.00 75.71 A C ATOM 536 O GLY A 72 -5.083 7.750 7.197 1.00 74.05 A O ATOM 537 N LEU A 73 -4.848 5.750 6.208 1.00 73.91 A N ATOM 538 CA LEU A 73 -4.942 6.201 4.824 1.00 75.27 A C ATOM 539 C LEU A 73 -5.920 5.307 4.078 1.00 76.23 A C ATOM 540 O LEU A 73 -5.863 4.088 4.197 1.00 75.01 A O ATOM 541 CB LEU A 73 -3.565 6.160 4.152 1.00 73.14 A C ATOM 542 CG LEU A 73 -2.529 7.139 4.727 1.00 66.80 A C ATOM 543 CD1 LEU A 73 -1.192 6.864 4.056 1.00 64.66 A C ATOM 544 CD2 LEU A 73 -2.903 8.602 4.475 1.00 64.30 A C ATOM 545 N GLN A 74 -6.777 5.910 3.269 1.00 76.63 A N ATOM 546 CA GLN A 74 -7.688 5.177 2.407 1.00 78.61 A C ATOM 547 C GLN A 74 -7.650 5.751 0.997 1.00 78.40 A C ATOM 548 O GLN A 74 -7.634 6.965 0.800 1.00 77.51 A O ATOM 549 CB GLN A 74 -9.095 5.183 3.013 1.00 77.99 A C ATOM 550 CG GLN A 74 -10.076 4.316 2.207 1.00 73.27 A C ATOM 551 CD GLN A 74 -11.451 4.226 2.875 1.00 72.11 A C ATOM 552 NE2 GLN A 74 -12.519 4.367 2.141 1.00 63.03 A N ATOM 553 OE1 GLN A 74 -11.577 4.015 4.063 1.00 67.47 A O ATOM 554 N SER A 75 -7.678 4.878 -0.003 1.00 79.18 A N ATOM 555 CA SER A 75 -7.836 5.274 -1.393 1.00 78.99 A C ATOM 556 C SER A 75 -8.723 4.290 -2.138 1.00 80.17 A C ATOM 557 O SER A 75 -8.496 3.089 -2.061 1.00 79.65 A O ATOM 558 CB SER A 75 -6.468 5.399 -2.068 1.00 76.26 A C ATOM 559 OG SER A 75 -5.793 4.152 -2.115 1.00 69.79 A O ATOM 560 N LYS A 76 -9.688 4.802 -2.903 1.00 79.99 A N ATOM 561 CA LYS A 76 -10.514 4.011 -3.822 1.00 81.00 A C ATOM 562 C LYS A 76 -10.107 4.349 -5.241 1.00 81.17 A C ATOM 563 O LYS A 76 -10.108 5.525 -5.605 1.00 80.41 A O ATOM 564 CB LYS A 76 -11.996 4.284 -3.543 1.00 80.49 A C ATOM 565 CG LYS A 76 -12.922 3.372 -4.363 1.00 76.37 A C ATOM 566 CD LYS A 76 -14.389 3.558 -3.944 1.00 75.70 A C ATOM 567 CE LYS A 76 -15.287 2.538 -4.646 1.00 69.07 A C ATOM 568 NZ LYS A 76 -16.686 2.544 -4.137 1.00 62.82 A N1+ ATOM 569 N ARG A 77 -9.729 3.348 -6.039 1.00 83.90 A N ATOM 570 CA ARG A 77 -9.175 3.561 -7.381 1.00 83.53 A C ATOM 571 C ARG A 77 -9.471 2.399 -8.319 1.00 85.02 A C ATOM 572 O ARG A 77 -9.729 1.286 -7.871 1.00 83.82 A O ATOM 573 CB ARG A 77 -7.669 3.813 -7.285 1.00 80.27 A C ATOM 574 CG ARG A 77 -6.879 2.580 -6.805 1.00 75.69 A C ATOM 575 CD ARG A 77 -5.402 2.917 -6.645 1.00 74.25 A C ATOM 576 NE ARG A 77 -5.154 3.764 -5.468 1.00 70.27 A N ATOM 577 CZ ARG A 77 -4.130 4.570 -5.294 1.00 65.45 A C ATOM 578 NH1 ARG A 77 -3.202 4.710 -6.178 1.00 61.87 A N1+ ATOM 579 NH2 ARG A 77 -4.027 5.258 -4.209 1.00 58.53 A N ATOM 580 N LYS A 78 -9.353 2.658 -9.597 1.00 83.43 A N ATOM 581 CA LYS A 78 -9.307 1.629 -10.634 1.00 83.87 A C ATOM 582 C LYS A 78 -7.854 1.198 -10.861 1.00 84.17 A C ATOM 583 O LYS A 78 -6.929 2.009 -10.754 1.00 84.12 A O ATOM 584 CB LYS A 78 -9.974 2.200 -11.889 1.00 82.49 A C ATOM 585 CG LYS A 78 -10.103 1.168 -13.001 1.00 76.74 A C ATOM 586 CD LYS A 78 -10.943 1.758 -14.132 1.00 75.24 A C ATOM 587 CE LYS A 78 -11.173 0.710 -15.210 1.00 68.37 A C ATOM 588 NZ LYS A 78 -12.412 1.035 -15.957 1.00 61.39 A N1+ ATOM 589 N LEU A 79 -7.639 -0.084 -11.162 1.00 84.40 A N ATOM 590 CA LEU A 79 -6.312 -0.562 -11.563 1.00 84.69 A C ATOM 591 C LEU A 79 -5.908 0.066 -12.904 1.00 85.42 A C ATOM 592 O LEU A 79 -6.723 0.155 -13.815 1.00 84.52 A O ATOM 593 CB LEU A 79 -6.293 -2.098 -11.639 1.00 82.94 A C ATOM 594 CG LEU A 79 -6.521 -2.816 -10.301 1.00 79.53 A C ATOM 595 CD1 LEU A 79 -6.548 -4.328 -10.537 1.00 76.51 A C ATOM 596 CD2 LEU A 79 -5.434 -2.521 -9.277 1.00 75.65 A C ATOM 597 N GLY A 80 -4.656 0.503 -13.011 1.00 86.13 A N ATOM 598 CA GLY A 80 -4.121 1.203 -14.179 1.00 87.38 A C ATOM 599 C GLY A 80 -4.441 2.701 -14.240 1.00 89.19 A C ATOM 600 O GLY A 80 -3.912 3.389 -15.106 1.00 87.84 A O ATOM 601 N GLU A 81 -5.265 3.216 -13.328 1.00 87.20 A N ATOM 602 CA GLU A 81 -5.595 4.645 -13.259 1.00 87.64 A C ATOM 603 C GLU A 81 -4.560 5.401 -12.417 1.00 87.85 A C ATOM 604 O GLU A 81 -4.327 5.060 -11.248 1.00 87.22 A O ATOM 605 CB GLU A 81 -7.016 4.801 -12.704 1.00 85.89 A C ATOM 606 CG GLU A 81 -7.537 6.239 -12.716 1.00 78.12 A C ATOM 607 CD GLU A 81 -8.965 6.365 -12.139 1.00 75.84 A C ATOM 608 OE1 GLU A 81 -9.549 7.464 -12.213 1.00 68.64 A O ATOM 609 OE2 GLU A 81 -9.495 5.351 -11.608 1.00 69.84 A O1- ATOM 610 N GLU A 82 -3.963 6.435 -12.994 1.00 90.01 A N ATOM 611 CA GLU A 82 -3.124 7.376 -12.257 1.00 90.63 A C ATOM 612 C GLU A 82 -4.004 8.376 -11.499 1.00 89.41 A C ATOM 613 O GLU A 82 -4.919 8.969 -12.055 1.00 88.04 A O ATOM 614 CB GLU A 82 -2.130 8.086 -13.184 1.00 90.54 A C ATOM 615 CG GLU A 82 -1.126 8.921 -12.384 1.00 89.20 A C ATOM 616 CD GLU A 82 -0.078 9.596 -13.282 1.00 88.77 A C ATOM 617 OE1 GLU A 82 -0.335 10.751 -13.695 1.00 82.75 A O ATOM 618 OE2 GLU A 82 0.988 8.985 -13.497 1.00 83.71 A O1- ATOM 619 N VAL A 83 -3.719 8.563 -10.224 1.00 87.90 A N ATOM 620 CA VAL A 83 -4.444 9.487 -9.349 1.00 86.99 A C ATOM 621 C VAL A 83 -3.478 10.350 -8.552 1.00 87.79 A C ATOM 622 O VAL A 83 -2.371 9.930 -8.212 1.00 87.56 A O ATOM 623 CB VAL A 83 -5.414 8.751 -8.410 1.00 85.09 A C ATOM 624 CG1 VAL A 83 -6.449 7.922 -9.178 1.00 79.43 A C ATOM 625 CG2 VAL A 83 -4.712 7.832 -7.414 1.00 79.39 A C ATOM 626 N ASP A 84 -3.935 11.558 -8.202 1.00 86.26 A N ATOM 627 CA ASP A 84 -3.293 12.348 -7.161 1.00 84.80 A C ATOM 628 C ASP A 84 -3.508 11.677 -5.801 1.00 83.00 A C ATOM 629 O ASP A 84 -4.629 11.318 -5.435 1.00 81.00 A O ATOM 630 CB ASP A 84 -3.828 13.787 -7.162 1.00 84.51 A C ATOM 631 CG ASP A 84 -3.340 14.526 -8.403 1.00 81.06 A C ATOM 632 OD1 ASP A 84 -2.125 14.800 -8.474 1.00 78.23 A O ATOM 633 OD2 ASP A 84 -4.113 14.742 -9.356 1.00 76.99 A O1- ATOM 634 N GLN A 85 -2.438 11.497 -5.041 1.00 82.56 A N ATOM 635 CA GLN A 85 -2.495 10.826 -3.753 1.00 80.70 A C ATOM 636 C GLN A 85 -1.860 11.670 -2.650 1.00 79.12 A C ATOM 637 O GLN A 85 -0.687 12.016 -2.702 1.00 75.58 A O ATOM 638 CB GLN A 85 -1.864 9.430 -3.861 1.00 78.59 A C ATOM 639 CG GLN A 85 -2.025 8.672 -2.531 1.00 75.44 A C ATOM 640 CD GLN A 85 -1.651 7.209 -2.571 1.00 73.67 A C ATOM 641 NE2 GLN A 85 -1.986 6.472 -1.524 1.00 65.49 A N ATOM 642 OE1 GLN A 85 -1.080 6.648 -3.486 1.00 69.06 A O ATOM 643 N ASN A 86 -2.631 11.883 -1.591 1.00 74.43 A N ATOM 644 CA ASN A 86 -2.061 12.301 -0.318 1.00 71.40 A C ATOM 645 C ASN A 86 -1.447 11.076 0.367 1.00 70.51 A C ATOM 646 O ASN A 86 -2.089 10.022 0.477 1.00 66.29 A O ATOM 647 CB ASN A 86 -3.142 12.957 0.550 1.00 67.22 A C ATOM 648 CG ASN A 86 -3.642 14.269 -0.028 1.00 60.57 A C ATOM 649 ND2 ASN A 86 -4.805 14.706 0.350 1.00 54.33 A N ATOM 650 OD1 ASN A 86 -3.000 14.925 -0.830 1.00 55.79 A O ATOM 651 N THR A 87 -0.212 11.204 0.814 1.00 69.46 A N ATOM 652 CA THR A 87 0.489 10.142 1.535 1.00 67.94 A C ATOM 653 C THR A 87 0.730 10.546 2.980 1.00 66.52 A C ATOM 654 O THR A 87 0.544 11.687 3.386 1.00 62.27 A O ATOM 655 CB THR A 87 1.801 9.735 0.852 1.00 65.54 A C ATOM 656 CG2 THR A 87 1.653 9.467 -0.635 1.00 61.55 A C ATOM 657 OG1 THR A 87 2.769 10.721 1.053 1.00 62.10 A O ATOM 658 N ALA A 88 1.152 9.580 3.754 1.00 63.64 A N ATOM 659 CA ALA A 88 1.480 9.759 5.150 1.00 61.79 A C ATOM 660 C ALA A 88 2.554 10.826 5.418 1.00 61.85 A C ATOM 661 O ALA A 88 2.460 11.564 6.398 1.00 57.14 A O ATOM 662 CB ALA A 88 1.939 8.381 5.616 1.00 57.81 A C ATOM 663 N ASN A 89 3.553 10.904 4.534 1.00 60.46 A N ATOM 664 CA ASN A 89 4.750 11.735 4.694 1.00 59.45 A C ATOM 665 C ASN A 89 4.871 12.807 3.599 1.00 59.07 A C ATOM 666 O ASN A 89 5.674 13.721 3.709 1.00 55.75 A O ATOM 667 CB ASN A 89 5.979 10.818 4.709 1.00 55.58 A C ATOM 668 CG ASN A 89 5.967 9.778 5.812 1.00 51.00 A C ATOM 669 ND2 ASN A 89 6.687 8.695 5.644 1.00 47.74 A N ATOM 670 OD1 ASN A 89 5.286 9.883 6.824 1.00 47.88 A O ATOM 671 N LEU A 90 4.066 12.697 2.530 1.00 57.04 A N ATOM 672 CA LEU A 90 4.090 13.563 1.359 1.00 57.26 A C ATOM 673 C LEU A 90 2.661 14.055 1.122 1.00 60.35 A C ATOM 674 O LEU A 90 1.806 13.310 0.643 1.00 55.79 A O ATOM 675 CB LEU A 90 4.618 12.782 0.143 1.00 52.02 A C ATOM 676 CG LEU A 90 6.014 12.169 0.332 1.00 49.55 A C ATOM 677 CD1 LEU A 90 6.299 11.186 -0.801 1.00 48.09 A C ATOM 678 CD2 LEU A 90 7.100 13.246 0.346 1.00 48.44 A C ATOM 679 N SER A 91 2.392 15.284 1.519 1.00 51.84 A N ATOM 680 CA SER A 91 1.017 15.787 1.595 1.00 51.63 A C ATOM 681 C SER A 91 0.427 16.254 0.258 1.00 55.13 A C ATOM 682 O SER A 91 -0.790 16.392 0.163 1.00 50.81 A O ATOM 683 CB SER A 91 0.939 16.894 2.642 1.00 44.08 A C ATOM 684 OG SER A 91 1.873 17.916 2.360 1.00 39.38 A O ATOM 685 N LYS A 92 1.256 16.532 -0.765 1.00 69.58 A N ATOM 686 CA LYS A 92 0.810 17.066 -2.058 1.00 70.73 A C ATOM 687 C LYS A 92 1.701 16.604 -3.218 1.00 73.60 A C ATOM 688 O LYS A 92 2.858 16.283 -3.015 1.00 69.67 A O ATOM 689 CB LYS A 92 0.788 18.615 -2.025 1.00 65.81 A C ATOM 690 CG LYS A 92 -0.209 19.176 -1.000 1.00 59.09 A C ATOM 691 CD LYS A 92 -0.331 20.700 -1.093 1.00 55.64 A C ATOM 692 CE LYS A 92 -1.325 21.187 -0.024 1.00 49.89 A C ATOM 693 NZ LYS A 92 -1.477 22.657 -0.047 1.00 43.16 A N1+ ATOM 694 N GLY A 93 1.151 16.632 -4.431 1.00 82.52 A N ATOM 695 CA GLY A 93 1.900 16.450 -5.673 1.00 85.47 A C ATOM 696 C GLY A 93 2.350 15.017 -5.975 1.00 88.25 A C ATOM 697 O GLY A 93 3.127 14.816 -6.901 1.00 86.60 A O ATOM 698 N VAL A 94 1.869 14.031 -5.223 1.00 85.59 A N ATOM 699 CA VAL A 94 2.200 12.627 -5.466 1.00 86.84 A C ATOM 700 C VAL A 94 1.253 12.059 -6.519 1.00 87.54 A C ATOM 701 O VAL A 94 0.048 11.972 -6.293 1.00 87.08 A O ATOM 702 CB VAL A 94 2.149 11.782 -4.191 1.00 85.31 A C ATOM 703 CG1 VAL A 94 2.611 10.343 -4.455 1.00 81.91 A C ATOM 704 CG2 VAL A 94 3.053 12.373 -3.100 1.00 82.39 A C ATOM 705 N LYS A 95 1.803 11.619 -7.643 1.00 89.54 A N ATOM 706 CA LYS A 95 1.100 10.809 -8.638 1.00 90.26 A C ATOM 707 C LYS A 95 1.255 9.336 -8.289 1.00 90.98 A C ATOM 708 O LYS A 95 2.360 8.886 -7.987 1.00 90.50 A O ATOM 709 CB LYS A 95 1.630 11.117 -10.046 1.00 89.91 A C ATOM 710 CG LYS A 95 1.359 12.554 -10.510 1.00 87.20 A C ATOM 711 CD LYS A 95 -0.137 12.877 -10.561 1.00 82.57 A C ATOM 712 CE LYS A 95 -0.417 14.237 -11.211 1.00 78.63 A C ATOM 713 NZ LYS A 95 -1.860 14.524 -11.195 1.00 69.05 A N1+ ATOM 714 N SER A 96 0.168 8.588 -8.301 1.00 89.91 A N ATOM 715 CA SER A 96 0.166 7.182 -7.919 1.00 89.56 A C ATOM 716 C SER A 96 -0.664 6.340 -8.868 1.00 89.97 A C ATOM 717 O SER A 96 -1.821 6.659 -9.130 1.00 89.01 A O ATOM 718 CB SER A 96 -0.358 7.038 -6.493 1.00 87.09 A C ATOM 719 OG SER A 96 -0.406 5.670 -6.106 1.00 77.90 A O ATOM 720 N VAL A 97 -0.116 5.223 -9.307 1.00 89.44 A N ATOM 721 CA VAL A 97 -0.812 4.212 -10.104 1.00 90.24 A C ATOM 722 C VAL A 97 -0.628 2.841 -9.468 1.00 89.26 A C ATOM 723 O VAL A 97 0.424 2.549 -8.896 1.00 88.99 A O ATOM 724 CB VAL A 97 -0.353 4.273 -11.578 1.00 90.79 A C ATOM 725 CG1 VAL A 97 1.128 3.937 -11.770 1.00 84.60 A C ATOM 726 CG2 VAL A 97 -1.199 3.347 -12.468 1.00 83.83 A C ATOM 727 N VAL A 98 -1.663 2.000 -9.531 1.00 87.60 A N ATOM 728 CA VAL A 98 -1.595 0.594 -9.116 1.00 86.53 A C ATOM 729 C VAL A 98 -1.896 -0.279 -10.318 1.00 86.46 A C ATOM 730 O VAL A 98 -3.005 -0.225 -10.852 1.00 86.24 A O ATOM 731 CB VAL A 98 -2.544 0.267 -7.950 1.00 84.99 A C ATOM 732 CG1 VAL A 98 -2.424 -1.203 -7.519 1.00 81.67 A C ATOM 733 CG2 VAL A 98 -2.236 1.130 -6.722 1.00 81.41 A C ATOM 734 N ASN A 99 -0.945 -1.093 -10.733 1.00 87.30 A N ATOM 735 CA ASN A 99 -1.089 -2.051 -11.822 1.00 86.90 A C ATOM 736 C ASN A 99 -1.122 -3.476 -11.278 1.00 86.26 A C ATOM 737 O ASN A 99 -0.545 -3.775 -10.236 1.00 85.52 A O ATOM 738 CB ASN A 99 0.058 -1.847 -12.823 1.00 87.84 A C ATOM 739 CG ASN A 99 -0.070 -0.524 -13.545 1.00 87.17 A C ATOM 740 ND2 ASN A 99 0.892 0.359 -13.418 1.00 82.18 A N ATOM 741 OD1 ASN A 99 -1.053 -0.266 -14.214 1.00 83.36 A O ATOM 742 N LEU A 100 -1.764 -4.367 -12.019 1.00 84.45 A N ATOM 743 CA LEU A 100 -1.647 -5.803 -11.787 1.00 84.21 A C ATOM 744 C LEU A 100 -0.579 -6.368 -12.733 1.00 85.37 A C ATOM 745 O LEU A 100 -0.690 -6.245 -13.947 1.00 84.91 A O ATOM 746 CB LEU A 100 -3.020 -6.458 -11.984 1.00 81.84 A C ATOM 747 CG LEU A 100 -3.059 -7.923 -11.518 1.00 74.50 A C ATOM 748 CD1 LEU A 100 -2.977 -8.054 -9.993 1.00 70.68 A C ATOM 749 CD2 LEU A 100 -4.379 -8.543 -11.952 1.00 70.11 A C ATOM 750 N VAL A 101 0.444 -6.992 -12.167 1.00 86.13 A N ATOM 751 CA VAL A 101 1.532 -7.640 -12.899 1.00 87.36 A C ATOM 752 C VAL A 101 1.576 -9.108 -12.473 1.00 87.48 A C ATOM 753 O VAL A 101 2.053 -9.444 -11.394 1.00 86.68 A O ATOM 754 CB VAL A 101 2.879 -6.930 -12.675 1.00 87.71 A C ATOM 755 CG1 VAL A 101 3.990 -7.596 -13.501 1.00 86.70 A C ATOM 756 CG2 VAL A 101 2.812 -5.448 -13.074 1.00 86.25 A C ATOM 757 N GLY A 102 1.032 -9.984 -13.314 1.00 84.82 A N ATOM 758 CA GLY A 102 0.761 -11.364 -12.911 1.00 83.91 A C ATOM 759 C GLY A 102 -0.227 -11.398 -11.748 1.00 84.29 A C ATOM 760 O GLY A 102 -1.318 -10.856 -11.862 1.00 82.99 A O ATOM 761 N GLU A 103 0.162 -11.981 -10.617 1.00 84.81 A N ATOM 762 CA GLU A 103 -0.656 -12.010 -9.392 1.00 85.24 A C ATOM 763 C GLU A 103 -0.299 -10.891 -8.386 1.00 86.57 A C ATOM 764 O GLU A 103 -0.806 -10.880 -7.270 1.00 85.17 A O ATOM 765 CB GLU A 103 -0.576 -13.399 -8.727 1.00 83.38 A C ATOM 766 CG GLU A 103 -1.042 -14.551 -9.631 1.00 80.22 A C ATOM 767 CD GLU A 103 -1.452 -15.792 -8.806 1.00 76.21 A C ATOM 768 OE1 GLU A 103 -2.526 -16.367 -9.094 1.00 69.56 A O ATOM 769 OE2 GLU A 103 -0.798 -16.115 -7.795 1.00 69.58 A O1- ATOM 770 N LYS A 104 0.568 -9.952 -8.773 1.00 85.30 A N ATOM 771 CA LYS A 104 1.082 -8.912 -7.878 1.00 86.23 A C ATOM 772 C LYS A 104 0.401 -7.573 -8.144 1.00 85.72 A C ATOM 773 O LYS A 104 0.262 -7.161 -9.292 1.00 85.72 A O ATOM 774 CB LYS A 104 2.604 -8.773 -8.004 1.00 87.79 A C ATOM 775 CG LYS A 104 3.336 -10.119 -7.870 1.00 88.83 A C ATOM 776 CD LYS A 104 4.848 -9.929 -7.721 1.00 87.90 A C ATOM 777 CE LYS A 104 5.517 -11.297 -7.645 1.00 85.14 A C ATOM 778 NZ LYS A 104 6.732 -11.280 -6.805 1.00 80.18 A N1+ ATOM 779 N HIS A 105 0.061 -6.863 -7.081 1.00 86.71 A N ATOM 780 CA HIS A 105 -0.278 -5.446 -7.173 1.00 86.06 A C ATOM 781 C HIS A 105 1.005 -4.630 -7.071 1.00 87.27 A C ATOM 782 O HIS A 105 1.683 -4.663 -6.046 1.00 86.82 A O ATOM 783 CB HIS A 105 -1.272 -5.053 -6.073 1.00 84.03 A C ATOM 784 CG HIS A 105 -2.634 -5.671 -6.187 1.00 77.48 A C ATOM 785 CD2 HIS A 105 -3.194 -6.280 -7.280 1.00 66.98 A C ATOM 786 ND1 HIS A 105 -3.592 -5.692 -5.187 1.00 67.18 A N ATOM 787 CE1 HIS A 105 -4.687 -6.305 -5.676 1.00 63.81 A C ATOM 788 NE2 HIS A 105 -4.484 -6.671 -6.945 1.00 65.55 A N ATOM 789 N VAL A 106 1.323 -3.891 -8.130 1.00 87.61 A N ATOM 790 CA VAL A 106 2.493 -3.018 -8.198 1.00 89.32 A C ATOM 791 C VAL A 106 2.016 -1.578 -8.161 1.00 88.76 A C ATOM 792 O VAL A 106 1.412 -1.090 -9.114 1.00 88.24 A O ATOM 793 CB VAL A 106 3.345 -3.318 -9.443 1.00 90.91 A C ATOM 794 CG1 VAL A 106 4.580 -2.417 -9.480 1.00 90.80 A C ATOM 795 CG2 VAL A 106 3.811 -4.781 -9.449 1.00 89.56 A C ATOM 796 N LYS A 107 2.269 -0.910 -7.056 1.00 89.65 A N ATOM 797 CA LYS A 107 1.972 0.512 -6.873 1.00 89.81 A C ATOM 798 C LYS A 107 3.239 1.318 -7.098 1.00 91.02 A C ATOM 799 O LYS A 107 4.239 1.082 -6.439 1.00 91.44 A O ATOM 800 CB LYS A 107 1.364 0.719 -5.482 1.00 88.52 A C ATOM 801 CG LYS A 107 1.090 2.193 -5.174 1.00 85.69 A C ATOM 802 CD LYS A 107 0.567 2.326 -3.737 1.00 83.40 A C ATOM 803 CE LYS A 107 0.385 3.799 -3.415 1.00 76.23 A C ATOM 804 NZ LYS A 107 0.145 4.020 -1.964 1.00 72.00 A N1+ ATOM 805 N VAL A 108 3.158 2.312 -7.980 1.00 90.70 A N ATOM 806 CA VAL A 108 4.233 3.275 -8.210 1.00 92.01 A C ATOM 807 C VAL A 108 3.757 4.644 -7.746 1.00 91.22 A C ATOM 808 O VAL A 108 2.630 5.043 -8.037 1.00 90.91 A O ATOM 809 CB VAL A 108 4.664 3.287 -9.685 1.00 93.21 A C ATOM 810 CG1 VAL A 108 5.820 4.266 -9.914 1.00 92.02 A C ATOM 811 CG2 VAL A 108 5.131 1.894 -10.134 1.00 91.20 A C ATOM 812 N GLN A 109 4.611 5.358 -7.016 1.00 91.71 A N ATOM 813 CA GLN A 109 4.395 6.746 -6.639 1.00 91.26 A C ATOM 814 C GLN A 109 5.525 7.614 -7.200 1.00 91.83 A C ATOM 815 O GLN A 109 6.686 7.242 -7.092 1.00 91.96 A O ATOM 816 CB GLN A 109 4.324 6.906 -5.122 1.00 89.49 A C ATOM 817 CG GLN A 109 3.076 6.270 -4.524 1.00 85.82 A C ATOM 818 CD GLN A 109 3.008 6.451 -3.007 1.00 85.12 A C ATOM 819 NE2 GLN A 109 1.859 6.689 -2.458 1.00 77.83 A N ATOM 820 OE1 GLN A 109 3.976 6.380 -2.276 1.00 80.38 A O ATOM 821 N LYS A 110 5.170 8.780 -7.741 1.00 90.59 A N ATOM 822 CA LYS A 110 6.109 9.754 -8.299 1.00 91.31 A C ATOM 823 C LYS A 110 5.831 11.140 -7.741 1.00 90.66 A C ATOM 824 O LYS A 110 4.678 11.550 -7.678 1.00 90.21 A O ATOM 825 CB LYS A 110 6.040 9.770 -9.829 1.00 92.80 A C ATOM 826 CG LYS A 110 6.422 8.415 -10.430 1.00 92.91 A C ATOM 827 CD LYS A 110 6.466 8.448 -11.963 1.00 91.65 A C ATOM 828 CE LYS A 110 6.806 7.026 -12.367 1.00 89.49 A C ATOM 829 NZ LYS A 110 7.362 6.874 -13.720 1.00 84.21 A N1+ ATOM 830 N TRP A 111 6.884 11.855 -7.375 1.00 90.64 A N ATOM 831 CA TRP A 111 6.832 13.247 -6.923 1.00 90.24 A C ATOM 832 C TRP A 111 8.216 13.884 -7.049 1.00 90.69 A C ATOM 833 O TRP A 111 9.228 13.222 -6.842 1.00 90.13 A O ATOM 834 CB TRP A 111 6.371 13.314 -5.463 1.00 88.89 A C ATOM 835 CG TRP A 111 7.371 12.821 -4.459 1.00 87.86 A C ATOM 836 CD1 TRP A 111 8.162 13.612 -3.698 1.00 87.22 A C ATOM 837 CD2 TRP A 111 7.754 11.453 -4.140 1.00 87.63 A C ATOM 838 CE2 TRP A 111 8.809 11.498 -3.187 1.00 85.87 A C ATOM 839 CE3 TRP A 111 7.332 10.188 -4.574 1.00 84.59 A C ATOM 840 NE1 TRP A 111 9.008 12.830 -2.938 1.00 85.19 A N ATOM 841 CZ2 TRP A 111 9.442 10.336 -2.697 1.00 82.96 A C ATOM 842 CZ3 TRP A 111 7.942 9.009 -4.091 1.00 83.79 A C ATOM 843 CH2 TRP A 111 8.997 9.085 -3.164 1.00 82.93 A C ATOM 844 N ASP A 112 8.300 15.146 -7.388 1.00 88.58 A N ATOM 845 CA ASP A 112 9.545 15.929 -7.410 1.00 88.68 A C ATOM 846 C ASP A 112 10.745 15.209 -8.060 1.00 89.60 A C ATOM 847 O ASP A 112 11.879 15.260 -7.574 1.00 88.41 A O ATOM 848 CB ASP A 112 9.853 16.466 -5.997 1.00 86.25 A C ATOM 849 CG ASP A 112 8.717 17.322 -5.421 1.00 81.07 A C ATOM 850 OD1 ASP A 112 7.959 17.906 -6.232 1.00 78.41 A O ATOM 851 OD2 ASP A 112 8.598 17.361 -4.187 1.00 77.22 A O1- ATOM 852 N GLY A 113 10.501 14.480 -9.168 1.00 90.01 A N ATOM 853 CA GLY A 113 11.521 13.700 -9.874 1.00 90.88 A C ATOM 854 C GLY A 113 11.952 12.403 -9.159 1.00 91.30 A C ATOM 855 O GLY A 113 12.816 11.703 -9.678 1.00 90.27 A O ATOM 856 N LYS A 114 11.351 12.073 -8.010 1.00 90.48 A N ATOM 857 CA LYS A 114 11.570 10.823 -7.281 1.00 90.40 A C ATOM 858 C LYS A 114 10.511 9.781 -7.635 1.00 92.06 A C ATOM 859 O LYS A 114 9.406 10.119 -8.061 1.00 92.23 A O ATOM 860 CB LYS A 114 11.576 11.081 -5.768 1.00 88.54 A C ATOM 861 CG LYS A 114 12.652 12.081 -5.321 1.00 86.16 A C ATOM 862 CD LYS A 114 12.593 12.247 -3.800 1.00 82.73 A C ATOM 863 CE LYS A 114 13.649 13.233 -3.313 1.00 77.94 A C ATOM 864 NZ LYS A 114 13.646 13.319 -1.824 1.00 71.75 A N1+ ATOM 865 N GLU A 115 10.851 8.520 -7.407 1.00 91.02 A N ATOM 866 CA GLU A 115 9.954 7.378 -7.582 1.00 91.82 A C ATOM 867 C GLU A 115 10.149 6.392 -6.430 1.00 91.46 A C ATOM 868 O GLU A 115 11.264 6.159 -5.978 1.00 90.26 A O ATOM 869 CB GLU A 115 10.193 6.728 -8.954 1.00 91.85 A C ATOM 870 CG GLU A 115 9.231 5.566 -9.247 1.00 91.54 A C ATOM 871 CD GLU A 115 9.412 4.989 -10.664 1.00 91.17 A C ATOM 872 OE1 GLU A 115 9.892 3.859 -10.773 1.00 85.33 A O ATOM 873 OE2 GLU A 115 9.017 5.668 -11.647 1.00 86.51 A O1- ATOM 874 N THR A 116 9.048 5.802 -5.975 1.00 92.56 A N ATOM 875 CA THR A 116 9.050 4.649 -5.064 1.00 92.07 A C ATOM 876 C THR A 116 8.056 3.606 -5.533 1.00 92.80 A C ATOM 877 O THR A 116 7.020 3.924 -6.128 1.00 92.57 A O ATOM 878 CB THR A 116 8.790 5.085 -3.619 1.00 89.81 A C ATOM 879 CG2 THR A 116 7.374 5.602 -3.367 1.00 81.51 A C ATOM 880 OG1 THR A 116 9.002 4.002 -2.752 1.00 81.56 A O ATOM 881 N THR A 117 8.364 2.341 -5.285 1.00 91.85 A N ATOM 882 CA THR A 117 7.561 1.196 -5.719 1.00 92.59 A C ATOM 883 C THR A 117 7.174 0.339 -4.533 1.00 91.34 A C ATOM 884 O THR A 117 7.981 0.043 -3.654 1.00 90.45 A O ATOM 885 CB THR A 117 8.300 0.370 -6.779 1.00 93.39 A C ATOM 886 CG2 THR A 117 7.468 -0.797 -7.300 1.00 82.77 A C ATOM 887 OG1 THR A 117 8.576 1.188 -7.897 1.00 84.10 A O ATOM 888 N PHE A 118 5.922 -0.108 -4.539 1.00 90.70 A N ATOM 889 CA PHE A 118 5.388 -1.047 -3.585 1.00 89.76 A C ATOM 890 C PHE A 118 4.831 -2.257 -4.326 1.00 90.15 A C ATOM 891 O PHE A 118 3.995 -2.111 -5.221 1.00 89.29 A O ATOM 892 CB PHE A 118 4.303 -0.397 -2.734 1.00 88.04 A C ATOM 893 CG PHE A 118 4.674 0.917 -2.090 1.00 85.64 A C ATOM 894 CD1 PHE A 118 5.144 0.946 -0.764 1.00 82.65 A C ATOM 895 CD2 PHE A 118 4.516 2.130 -2.800 1.00 82.77 A C ATOM 896 CE1 PHE A 118 5.424 2.175 -0.144 1.00 80.54 A C ATOM 897 CE2 PHE A 118 4.803 3.351 -2.176 1.00 80.47 A C ATOM 898 CZ PHE A 118 5.248 3.377 -0.839 1.00 81.41 A C ATOM 899 N VAL A 119 5.265 -3.443 -3.939 1.00 89.02 A N ATOM 900 CA VAL A 119 4.780 -4.701 -4.494 1.00 90.28 A C ATOM 901 C VAL A 119 4.042 -5.454 -3.404 1.00 89.15 A C ATOM 902 O VAL A 119 4.609 -5.738 -2.350 1.00 88.73 A O ATOM 903 CB VAL A 119 5.927 -5.536 -5.083 1.00 91.80 A C ATOM 904 CG1 VAL A 119 5.386 -6.837 -5.699 1.00 91.24 A C ATOM 905 CG2 VAL A 119 6.659 -4.758 -6.187 1.00 90.29 A C ATOM 906 N MET A 120 2.784 -5.786 -3.658 1.00 88.28 A N ATOM 907 CA MET A 120 1.973 -6.622 -2.789 1.00 87.60 A C ATOM 908 C MET A 120 1.659 -7.944 -3.482 1.00 88.21 A C ATOM 909 O MET A 120 1.159 -7.957 -4.609 1.00 87.94 A O ATOM 910 CB MET A 120 0.699 -5.865 -2.400 1.00 85.44 A C ATOM 911 CG MET A 120 -0.152 -6.641 -1.405 1.00 75.43 A C ATOM 912 SD MET A 120 -1.846 -5.997 -1.261 1.00 70.39 A S ATOM 913 CE MET A 120 -2.531 -6.610 -2.822 1.00 60.20 A C ATOM 914 N GLU A 121 1.915 -9.047 -2.791 1.00 88.82 A N ATOM 915 CA GLU A 121 1.605 -10.390 -3.277 1.00 89.13 A C ATOM 916 C GLU A 121 1.097 -11.290 -2.155 1.00 89.28 A C ATOM 917 O GLU A 121 1.486 -11.152 -1.001 1.00 88.82 A O ATOM 918 CB GLU A 121 2.817 -10.996 -4.004 1.00 88.11 A C ATOM 919 CG GLU A 121 4.050 -11.296 -3.124 1.00 84.76 A C ATOM 920 CD GLU A 121 5.258 -11.725 -3.991 1.00 85.66 A C ATOM 921 OE1 GLU A 121 6.361 -11.150 -3.850 1.00 79.47 A O ATOM 922 OE2 GLU A 121 5.101 -12.559 -4.904 1.00 80.77 A O1- ATOM 923 N ILE A 122 0.218 -12.238 -2.502 1.00 87.51 A N ATOM 924 CA ILE A 122 -0.203 -13.284 -1.572 1.00 87.84 A C ATOM 925 C ILE A 122 0.715 -14.486 -1.761 1.00 87.92 A C ATOM 926 O ILE A 122 0.707 -15.129 -2.809 1.00 87.61 A O ATOM 927 CB ILE A 122 -1.699 -13.643 -1.749 1.00 87.25 A C ATOM 928 CG1 ILE A 122 -2.626 -12.417 -1.610 1.00 86.25 A C ATOM 929 CG2 ILE A 122 -2.093 -14.732 -0.736 1.00 86.25 A C ATOM 930 CD1 ILE A 122 -2.453 -11.593 -0.329 1.00 81.72 A C ATOM 931 N LYS A 123 1.499 -14.790 -0.734 1.00 89.64 A N ATOM 932 CA LYS A 123 2.462 -15.883 -0.720 1.00 90.01 A C ATOM 933 C LYS A 123 2.317 -16.688 0.568 1.00 90.93 A C ATOM 934 O LYS A 123 2.305 -16.116 1.653 1.00 90.57 A O ATOM 935 CB LYS A 123 3.868 -15.300 -0.902 1.00 88.76 A C ATOM 936 CG LYS A 123 4.912 -16.411 -1.065 1.00 82.51 A C ATOM 937 CD LYS A 123 6.294 -15.819 -1.298 1.00 81.61 A C ATOM 938 CE LYS A 123 7.295 -16.973 -1.400 1.00 74.59 A C ATOM 939 NZ LYS A 123 8.662 -16.469 -1.629 1.00 68.63 A N1+ ATOM 940 N ASP A 124 2.175 -17.993 0.446 1.00 89.04 A N ATOM 941 CA ASP A 124 2.056 -18.915 1.580 1.00 89.37 A C ATOM 942 C ASP A 124 0.964 -18.506 2.594 1.00 90.04 A C ATOM 943 O ASP A 124 1.134 -18.573 3.809 1.00 89.12 A O ATOM 944 CB ASP A 124 3.445 -19.165 2.204 1.00 88.91 A C ATOM 945 CG ASP A 124 4.474 -19.602 1.151 1.00 86.49 A C ATOM 946 OD1 ASP A 124 4.079 -20.399 0.274 1.00 83.27 A O ATOM 947 OD2 ASP A 124 5.614 -19.079 1.180 1.00 82.49 A O1- ATOM 948 N GLY A 125 -0.179 -18.016 2.071 1.00 89.34 A N ATOM 949 CA GLY A 125 -1.309 -17.548 2.884 1.00 88.45 A C ATOM 950 C GLY A 125 -1.085 -16.208 3.596 1.00 89.00 A C ATOM 951 O GLY A 125 -1.956 -15.769 4.350 1.00 87.23 A O ATOM 952 N LYS A 126 0.046 -15.541 3.355 1.00 88.43 A N ATOM 953 CA LYS A 126 0.371 -14.210 3.869 1.00 88.64 A C ATOM 954 C LYS A 126 0.272 -13.165 2.767 1.00 88.57 A C ATOM 955 O LYS A 126 0.537 -13.451 1.604 1.00 88.36 A O ATOM 956 CB LYS A 126 1.774 -14.202 4.492 1.00 88.13 A C ATOM 957 CG LYS A 126 1.918 -15.185 5.660 1.00 85.53 A C ATOM 958 CD LYS A 126 3.357 -15.128 6.196 1.00 83.34 A C ATOM 959 CE LYS A 126 3.569 -16.141 7.319 1.00 77.49 A C ATOM 960 NZ LYS A 126 4.984 -16.112 7.783 1.00 70.66 A N1+ ATOM 961 N ASN A 127 -0.067 -11.945 3.144 1.00 89.15 A N ATOM 962 CA ASN A 127 0.113 -10.781 2.296 1.00 88.44 A C ATOM 963 C ASN A 127 1.527 -10.243 2.532 1.00 88.35 A C ATOM 964 O ASN A 127 1.840 -9.830 3.649 1.00 87.41 A O ATOM 965 CB ASN A 127 -1.004 -9.780 2.608 1.00 86.86 A C ATOM 966 CG ASN A 127 -0.959 -8.524 1.759 1.00 84.11 A C ATOM 967 ND2 ASN A 127 -1.940 -7.677 1.897 1.00 76.15 A N ATOM 968 OD1 ASN A 127 -0.059 -8.286 0.971 1.00 77.72 A O ATOM 969 N VAL A 128 2.379 -10.291 1.518 1.00 88.99 A N ATOM 970 CA VAL A 128 3.747 -9.773 1.566 1.00 89.11 A C ATOM 971 C VAL A 128 3.789 -8.451 0.822 1.00 87.85 A C ATOM 972 O VAL A 128 3.352 -8.363 -0.330 1.00 87.21 A O ATOM 973 CB VAL A 128 4.765 -10.776 0.992 1.00 90.47 A C ATOM 974 CG1 VAL A 128 6.193 -10.235 1.093 1.00 89.64 A C ATOM 975 CG2 VAL A 128 4.706 -12.107 1.757 1.00 88.95 A C ATOM 976 N TYR A 129 4.284 -7.427 1.477 1.00 89.89 A N ATOM 977 CA TYR A 129 4.367 -6.064 0.983 1.00 89.07 A C ATOM 978 C TYR A 129 5.824 -5.616 0.972 1.00 90.05 A C ATOM 979 O TYR A 129 6.435 -5.450 2.022 1.00 89.16 A O ATOM 980 CB TYR A 129 3.490 -5.172 1.860 1.00 86.21 A C ATOM 981 CG TYR A 129 3.246 -3.797 1.294 1.00 80.15 A C ATOM 982 CD1 TYR A 129 3.945 -2.677 1.774 1.00 74.49 A C ATOM 983 CD2 TYR A 129 2.264 -3.641 0.286 1.00 73.15 A C ATOM 984 CE1 TYR A 129 3.628 -1.390 1.304 1.00 67.94 A C ATOM 985 CE2 TYR A 129 1.946 -2.354 -0.193 1.00 68.00 A C ATOM 986 CZ TYR A 129 2.615 -1.230 0.335 1.00 66.80 A C ATOM 987 OH TYR A 129 2.259 0.019 -0.079 1.00 65.43 A O ATOM 988 N THR A 130 6.378 -5.431 -0.220 1.00 89.61 A N ATOM 989 CA THR A 130 7.761 -4.987 -0.429 1.00 91.25 A C ATOM 990 C THR A 130 7.760 -3.535 -0.874 1.00 90.31 A C ATOM 991 O THR A 130 7.143 -3.212 -1.885 1.00 89.46 A O ATOM 992 CB THR A 130 8.473 -5.866 -1.465 1.00 93.05 A C ATOM 993 CG2 THR A 130 9.943 -5.489 -1.641 1.00 91.89 A C ATOM 994 OG1 THR A 130 8.437 -7.211 -1.058 1.00 92.81 A O ATOM 995 N HIS A 131 8.443 -2.675 -0.143 1.00 90.41 A N ATOM 996 CA HIS A 131 8.616 -1.259 -0.459 1.00 90.15 A C ATOM 997 C HIS A 131 10.060 -0.999 -0.887 1.00 91.28 A C ATOM 998 O HIS A 131 10.991 -1.338 -0.165 1.00 91.28 A O ATOM 999 CB HIS A 131 8.211 -0.424 0.766 1.00 87.70 A C ATOM 1000 CG HIS A 131 8.418 1.059 0.628 1.00 83.99 A C ATOM 1001 CD2 HIS A 131 8.438 1.811 -0.507 1.00 75.30 A C ATOM 1002 ND1 HIS A 131 8.607 1.931 1.698 1.00 76.07 A N ATOM 1003 CE1 HIS A 131 8.729 3.172 1.194 1.00 75.44 A C ATOM 1004 NE2 HIS A 131 8.635 3.139 -0.143 1.00 76.76 A N ATOM 1005 N THR A 132 10.255 -0.391 -2.055 1.00 91.09 A N ATOM 1006 CA THR A 132 11.564 -0.051 -2.604 1.00 92.30 A C ATOM 1007 C THR A 132 11.657 1.453 -2.858 1.00 91.32 A C ATOM 1008 O THR A 132 10.809 2.016 -3.553 1.00 90.17 A O ATOM 1009 CB THR A 132 11.840 -0.823 -3.902 1.00 93.60 A C ATOM 1010 CG2 THR A 132 13.248 -0.586 -4.443 1.00 91.76 A C ATOM 1011 OG1 THR A 132 11.709 -2.213 -3.667 1.00 92.55 A O ATOM 1012 N MET A 133 12.699 2.080 -2.336 1.00 90.64 A N ATOM 1013 CA MET A 133 13.052 3.473 -2.585 1.00 89.42 A C ATOM 1014 C MET A 133 14.566 3.587 -2.819 1.00 89.77 A C ATOM 1015 O MET A 133 15.354 3.473 -1.879 1.00 88.52 A O ATOM 1016 CB MET A 133 12.602 4.339 -1.402 1.00 87.01 A C ATOM 1017 CG MET A 133 12.975 5.817 -1.592 1.00 80.61 A C ATOM 1018 SD MET A 133 12.175 6.615 -3.003 1.00 76.83 A S ATOM 1019 CE MET A 133 13.039 8.209 -2.974 1.00 68.27 A C ATOM 1020 N GLY A 134 14.974 3.799 -4.078 1.00 89.22 A N ATOM 1021 CA GLY A 134 16.389 3.705 -4.440 1.00 90.48 A C ATOM 1022 C GLY A 134 16.957 2.337 -4.053 1.00 92.37 A C ATOM 1023 O GLY A 134 16.375 1.313 -4.404 1.00 91.67 A O ATOM 1024 N ASP A 135 18.048 2.334 -3.289 1.00 90.98 A N ATOM 1025 CA ASP A 135 18.710 1.111 -2.810 1.00 91.69 A C ATOM 1026 C ASP A 135 18.093 0.539 -1.520 1.00 92.25 A C ATOM 1027 O ASP A 135 18.498 -0.521 -1.048 1.00 90.09 A O ATOM 1028 CB ASP A 135 20.208 1.396 -2.619 1.00 90.62 A C ATOM 1029 CG ASP A 135 20.901 1.867 -3.903 1.00 86.91 A C ATOM 1030 OD1 ASP A 135 20.557 1.341 -4.984 1.00 81.45 A O ATOM 1031 OD2 ASP A 135 21.762 2.770 -3.787 1.00 81.73 A O1- ATOM 1032 N VAL A 136 17.122 1.232 -0.931 1.00 89.93 A N ATOM 1033 CA VAL A 136 16.478 0.787 0.311 1.00 89.92 A C ATOM 1034 C VAL A 136 15.283 -0.103 -0.020 1.00 90.84 A C ATOM 1035 O VAL A 136 14.376 0.302 -0.748 1.00 90.60 A O ATOM 1036 CB VAL A 136 16.071 1.974 1.201 1.00 87.64 A C ATOM 1037 CG1 VAL A 136 15.398 1.502 2.493 1.00 83.22 A C ATOM 1038 CG2 VAL A 136 17.315 2.793 1.592 1.00 83.31 A C ATOM 1039 N VAL A 137 15.275 -1.301 0.565 1.00 90.81 A N ATOM 1040 CA VAL A 137 14.174 -2.260 0.460 1.00 91.96 A C ATOM 1041 C VAL A 137 13.681 -2.602 1.856 1.00 91.06 A C ATOM 1042 O VAL A 137 14.459 -3.041 2.702 1.00 89.96 A O ATOM 1043 CB VAL A 137 14.593 -3.521 -0.311 1.00 92.60 A C ATOM 1044 CG1 VAL A 137 13.411 -4.492 -0.472 1.00 91.31 A C ATOM 1045 CG2 VAL A 137 15.111 -3.181 -1.713 1.00 90.62 A C ATOM 1046 N ALA A 138 12.377 -2.434 2.085 1.00 90.86 A N ATOM 1047 CA ALA A 138 11.676 -2.872 3.276 1.00 89.64 A C ATOM 1048 C ALA A 138 10.658 -3.963 2.922 1.00 90.35 A C ATOM 1049 O ALA A 138 10.064 -3.936 1.845 1.00 90.17 A O ATOM 1050 CB ALA A 138 11.004 -1.671 3.942 1.00 87.51 A C ATOM 1051 N VAL A 139 10.453 -4.921 3.817 1.00 89.15 A N ATOM 1052 CA VAL A 139 9.499 -6.012 3.612 1.00 90.23 A C ATOM 1053 C VAL A 139 8.638 -6.179 4.850 1.00 89.12 A C ATOM 1054 O VAL A 139 9.136 -6.488 5.931 1.00 88.51 A O ATOM 1055 CB VAL A 139 10.192 -7.337 3.246 1.00 91.69 A C ATOM 1056 CG1 VAL A 139 9.150 -8.430 2.940 1.00 90.66 A C ATOM 1057 CG2 VAL A 139 11.077 -7.188 1.997 1.00 89.70 A C ATOM 1058 N ASN A 140 7.329 -6.073 4.662 1.00 89.16 A N ATOM 1059 CA ASN A 140 6.339 -6.358 5.682 1.00 88.67 A C ATOM 1060 C ASN A 140 5.545 -7.596 5.287 1.00 89.98 A C ATOM 1061 O ASN A 140 5.148 -7.758 4.128 1.00 89.57 A O ATOM 1062 CB ASN A 140 5.443 -5.132 5.877 1.00 86.58 A C ATOM 1063 CG ASN A 140 6.211 -3.947 6.426 1.00 83.80 A C ATOM 1064 ND2 ASN A 140 5.971 -2.764 5.925 1.00 76.18 A N ATOM 1065 OD1 ASN A 140 7.034 -4.093 7.308 1.00 77.85 A O ATOM 1066 N SER A 141 5.254 -8.464 6.238 1.00 88.49 A N ATOM 1067 CA SER A 141 4.326 -9.568 6.034 1.00 88.73 A C ATOM 1068 C SER A 141 3.118 -9.443 6.950 1.00 88.69 A C ATOM 1069 O SER A 141 3.222 -9.038 8.109 1.00 87.82 A O ATOM 1070 CB SER A 141 5.028 -10.923 6.127 1.00 88.26 A C ATOM 1071 OG SER A 141 5.286 -11.310 7.458 1.00 78.92 A O ATOM 1072 N TYR A 142 1.959 -9.784 6.413 1.00 88.23 A N ATOM 1073 CA TYR A 142 0.690 -9.689 7.106 1.00 88.30 A C ATOM 1074 C TYR A 142 -0.021 -11.038 7.071 1.00 89.28 A C ATOM 1075 O TYR A 142 -0.072 -11.714 6.042 1.00 89.12 A O ATOM 1076 CB TYR A 142 -0.195 -8.596 6.500 1.00 87.48 A C ATOM 1077 CG TYR A 142 0.415 -7.202 6.411 1.00 85.92 A C ATOM 1078 CD1 TYR A 142 0.010 -6.199 7.310 1.00 82.87 A C ATOM 1079 CD2 TYR A 142 1.372 -6.908 5.419 1.00 82.94 A C ATOM 1080 CE1 TYR A 142 0.566 -4.907 7.225 1.00 80.75 A C ATOM 1081 CE2 TYR A 142 1.944 -5.623 5.341 1.00 80.76 A C ATOM 1082 CZ TYR A 142 1.543 -4.617 6.246 1.00 82.00 A C ATOM 1083 OH TYR A 142 2.097 -3.388 6.172 1.00 80.22 A O ATOM 1084 N ARG A 143 -0.627 -11.422 8.189 1.00 87.20 A N ATOM 1085 CA ARG A 143 -1.527 -12.575 8.284 1.00 86.75 A C ATOM 1086 C ARG A 143 -2.976 -12.116 8.194 1.00 86.88 A C ATOM 1087 O ARG A 143 -3.306 -11.024 8.665 1.00 86.41 A O ATOM 1088 CB ARG A 143 -1.242 -13.392 9.552 1.00 85.10 A C ATOM 1089 CG ARG A 143 -1.499 -12.606 10.854 1.00 75.96 A C ATOM 1090 CD ARG A 143 -1.141 -13.453 12.069 1.00 72.83 A C ATOM 1091 NE ARG A 143 -1.337 -12.699 13.321 1.00 64.03 A N ATOM 1092 CZ ARG A 143 -1.043 -13.112 14.545 1.00 56.33 A C ATOM 1093 NH1 ARG A 143 -0.545 -14.304 14.766 1.00 51.22 A N1+ ATOM 1094 NH2 ARG A 143 -1.252 -12.343 15.569 1.00 47.02 A N ATOM 1095 N ARG A 144 -3.832 -12.943 7.621 1.00 86.29 A N ATOM 1096 CA ARG A 144 -5.267 -12.649 7.548 1.00 86.16 A C ATOM 1097 C ARG A 144 -5.846 -12.503 8.955 1.00 85.24 A C ATOM 1098 O ARG A 144 -5.586 -13.331 9.830 1.00 83.15 A O ATOM 1099 CB ARG A 144 -5.969 -13.728 6.707 1.00 84.70 A C ATOM 1100 CG ARG A 144 -7.372 -13.289 6.288 1.00 80.57 A C ATOM 1101 CD ARG A 144 -8.022 -14.298 5.324 1.00 79.65 A C ATOM 1102 NE ARG A 144 -7.420 -14.302 3.974 1.00 78.43 A N ATOM 1103 CZ ARG A 144 -7.781 -13.560 2.936 1.00 76.13 A C ATOM 1104 NH1 ARG A 144 -8.689 -12.635 3.020 1.00 70.09 A N1+ ATOM 1105 NH2 ARG A 144 -7.237 -13.746 1.778 1.00 70.59 A N TER END If you find results from this site helpful for your research, please cite one of our papers:
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